3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide
TL;DR: 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide (CAS 873856-67-8) is a chemical compound with molecular formula C16H16N4OS and molecular weight 312.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide
Also Known As: 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide, (3-benzothiazol-2-ylpyrazin-2-yl)-N-(tert-butyl)carboxamide, 3-(benzo[d]thiazol-2-yl)-N-(tert-butyl)pyrazine-2-carboxamide
| Molecular Formula | C16H16N4OS |
|---|---|
| Molecular Weight | 312.10 g/mol |
| LogP | 3.2816 |
| Topological Polar Surface Area | 67.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 312.1045 |
| Heavy Atoms | 22 |
| Complexity | 802.27814 |
Chemical Identifiers
| CAS Number | 873856-67-8 |
|---|---|
| SMILES | CC(C)(C)NC(=O)C1=NC=CN=C1C2=NC3=CC=CC=C3S2 |
Product Overview
3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide (CAS 873856-67-8), with molecular formula C16H16N4OS and molecular weight 312.10 g/mol. IUPAC: 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide.
Chemical Property Profile of 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide
Property Insights of 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide
The XLogP value of 3.2816 indicates that 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide. Following Lipinski's Rule of Five, 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide?
The CAS number of 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide is 873856-67-8.
What is the molecular formula of 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide?
The molecular formula of 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide is C16H16N4OS.
What is the molecular weight of 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide?
The molecular weight of 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide is 312.10 g/mol.
Where can I buy 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide?
You can request a quote for 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,3-benzothiazol-2-yl)-N-tert-butylpyrazine-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.